SCHEMBL13352230

SCHEMBL13352230

Cc1ccccc1NC(=O)/C=C/c1ccccn1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 4/20 0.64
▸ MMP2 P08253 4/20 0.64
▸ MMP9 P14780 4/20 0.64
▸ EGFR P00533 1/20 0.64
▸ NPC1 O15118 5/20 0.57
▸ RAB9A P51151 5/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ KDM4E B2RXH2 1/20 0.51
▸ TP53BP1 Q12888 1/20 0.51
▸ BTK Q06187 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ XBP1 P17861 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ TLR9 Q9NR96 1/20 0.50
▸ HDAC3 O15379 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ TUBB4A P04350 1/20 0.49
▸ TUBB P07437 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2679758 0.84 HDAC3 (0.46) MMP1MMP2MMP9EGFRNPC1
SCHEMBL2679766 0.84 HDAC3 (0.46) MMP1MMP2MMP9EGFRNPC1
SCHEMBL13320651 0.81 TRPM2 (0.60) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL9767884 0.81 TRPM2 (0.60) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL2679660 0.80 ALDH1A1 (0.54) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL2679665 0.80 ALDH1A1 (0.54) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL6582938 0.80 NPC1 (0.51) MMP1MMP2MMP9EGFRNPC1
SCHEMBL6582936 0.80 NPC1 (0.51) MMP1MMP2MMP9EGFRNPC1
SCHEMBL13352237 0.79 MMP1 (0.78) MMP1MMP2MMP9EGFRNPC1
N-O-Tolylcinnamamide SCHEMBL2593756 0.78 MMP1 (1.00) MMP1MMP2MMP9EGFRNPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130497-A1 Therapeutic Compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2010-05-27 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100130497-A1 Therapeutic Compounds NFATC1, NAT1, AADAC MMP1 19/4885MMP2 88/4885MMP9 119/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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